N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(2,3-dimethyl-5-nitro-phenyl)sulfonyl-ethyl-amino]ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(2,3-dimethyl-5-nitro-phenyl)sulfonyl-ethyl-amino]ethanamide Openeye Name: 2-[(2,3-dimethyl-5-nitro-phenyl)sulfonyl-ethyl-amino]-N-(1,1-dioxothiolan-3-yl)acetamide CAS Name: 2-[(2,3-dimethyl-5-nitrophenyl)sulfonyl-ethylamino]-N-(1,1-dioxo-3-thiolanyl)acetamide IUPAC Name: 2-[(2,3-dimethyl-5-nitrophenyl)sulfonyl-ethylamino]-N-(1,1-dioxothiolan-3-yl)acetamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-[(2,3-dimethyl-5-nitro-phenyl)sulfonyl-ethyl-amino]acetamide Formula: C16H23N3O7S2 MolecularWeight: 433.49972

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1CCS(=O)(=O)C1)S(=O)(=O)C2=C(C(=CC(=C2)[N+](=O)[O-])C)C

Isomeric SMILES

CCN(CC(=O)NC1CCS(=O)(=O)C1)S(=O)(=O)C2=C(C(=CC(=C2)[N+](=O)[O-])C)C

InChI

InChI=1S/C16H23N3O7S2/c1-4-18(9-16(20)17-13-5-6-27(23,24)10-13)28(25,26)15-8-14(19(21)22)7-11(2)12(15)3/h7-8,13H,4-6,9-10H2,1-3H3,(H,17,20)